Molecular formula
C12H22O2

SMILES
CC(=O)O[C@H]1CCC[C@@H](C1)C(C)(C)C

Fragrance
Woody	81.01%
Fruity	71.82%
Floral	69.62%
Herbal	68.31%
Fresh	56.75%
Green	54.59%
Camphoreous	47.57%
Sweet	46.93%
Pine	46.13%
Mint	45.8%

 

Flavor
Sweet	63.98%
Herbal	60.45%
Woody	51.43%
Camphor	35.95%
Mint	33.62%
Green	33.46%
Citrus	33.42%
Minty	32.94%
Pine	32.69%
Tropical	32.63%

 

Odor impact est.
Medium

XLogP3-AA
3.6

pKa est.
8.64 (weak base)

Molecular weight
198.3 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Moderately slow

Boiling point est.
241°C

Flash point

• 100.29 ˚C est.

• NHUNEDUXIBOQML-QWRGUYRKSA-N
• NS00084729

[(1S,3S)-3-tert-butylcyclohexyl] acetate is primarily used as a fragrance ingredient and odorant fixative in perfumery, helping to extend scent release. It is also used as a fragrance component in cosmetics and personal care formulations. Additionally, in household products such as air fresheners and cleaners, it serves as a fragrance ingredient and scent modifier. In industrial manufacturing related to fragrance chemistry, it may be used as an intermediate or additive in fragrance formulations. It can also be used as a fragrance additive in coatings, inks, and surface-care formulations.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	1418.99
methanol	1538.48
isopropanol	1275.63
water	3.99
ethyl acetate	1296.95
n-propanol	1350.3
acetone	1626.57
n-butanol	1264.2
acetonitrile	985.73
DMF	1992.8
toluene	1039.1
isobutanol	1101.64
1,4-dioxane	1855.38
methyl acetate	1214.42
THF	2460.62
2-butanone	1505.01
n-pentanol	710.95
sec-butanol	1192.69
n-hexane	354.93
ethylene glycol	315.59
NMP	1662.69
cyclohexane	410.87
DMSO	1299.33
n-butyl acetate	888.62
n-octanol	454.24
chloroform	3448.55
n-propyl acetate	657.87
acetic acid	1151.64
dichloromethane	2138.24
cyclohexanone	1834.83
propylene glycol	570.65
isopropyl acetate	1058.82
DMAc	1871.45
2-ethoxyethanol	802.04
isopentanol	1150.16
n-heptane	90.9
ethyl formate	701.91
1,2-dichloroethane	1703.08
n-hexanol	1023.93
2-methoxyethanol	1405.35
isobutyl acetate	525.97
tetrachloromethane	747.64
n-pentyl acetate	524.72
transcutol	2739.89
n-heptanol	420.43
ethylbenzene	520.24
MIBK	846.48
2-propoxyethanol	1353.17
tert-butanol	1556.99
MTBE	1883.36
2-butoxyethanol	687.86
propionic acid	1085.51
o-xylene	624.1
formic acid	493.7
diethyl ether	1466.23
m-xylene	715.52
p-xylene	635.23
chlorobenzene	1185.06
dimethyl carbonate	499.0
n-octane	39.74
formamide	545.52
cyclopentanone	1845.94
2-pentanone	1297.61
anisole	837.14
cyclopentyl methyl ether	1448.05
gamma-butyrolactone	1765.74
1-methoxy-2-propanol	1235.51
pyridine	1440.02
3-pentanone	1030.65
furfural	1468.77
n-dodecane	27.29
diethylene glycol	827.63
diisopropyl ether	530.04
tert-amyl alcohol	1386.86
acetylacetone	1217.3
n-hexadecane	32.43
acetophenone	718.25
methyl propionate	1052.73
isopentyl acetate	912.92
trichloroethylene	2824.52
n-nonanol	389.86
cyclohexanol	1225.53
benzyl alcohol	625.94
2-ethylhexanol	527.94
isooctanol	341.64
dipropyl ether	521.1
1,2-dichlorobenzene	995.86
ethyl lactate	364.77
propylene carbonate	1091.89
n-methylformamide	1046.95
2-pentanol	935.9
n-pentane	261.71
1-propoxy-2-propanol	910.43
1-methoxy-2-propyl acetate	1000.07
2-(2-methoxypropoxy) propanol	644.98
mesitylene	453.66
ε-caprolactone	1520.63
p-cymene	248.95
epichlorohydrin	2035.99
1,1,1-trichloroethane	2161.17
2-aminoethanol	688.5
morpholine-4-carbaldehyde	1599.74
sulfolane	1829.47
2,2,4-trimethylpentane	137.25
2-methyltetrahydrofuran	2091.65
n-hexyl acetate	872.33
isooctane	102.57
2-(2-butoxyethoxy)ethanol	910.7
sec-butyl acetate	604.59
tert-butyl acetate	1134.46
decalin	184.13
glycerin	636.25
diglyme	1408.0
acrylic acid	861.96
isopropyl myristate	290.21
n-butyric acid	1328.89
acetyl acetate	856.64
di(2-ethylhexyl) phthalate	286.03
ethyl propionate	644.31
nitromethane	1472.12
1,2-diethoxyethane	814.01
benzonitrile	806.69
trioctyl phosphate	211.86
1-bromopropane	1294.54
gamma-valerolactone	2081.77
n-decanol	269.8
triethyl phosphate	264.92
4-methyl-2-pentanol	600.06
propionitrile	941.05
vinylene carbonate	954.93
1,1,2-trichlorotrifluoroethane	1526.31
DMS	712.19
cumene	353.74
2-octanol	293.51
2-hexanone	770.03
octyl acetate	385.66
limonene	373.01
1,2-dimethoxyethane	1300.76
ethyl orthosilicate	283.38
tributyl phosphate	289.59
diacetone alcohol	1045.54
N,N-dimethylaniline	568.13
acrylonitrile	974.15
aniline	1059.62
1,3-propanediol	844.14
bromobenzene	1239.13
dibromomethane	1687.67
1,1,2,2-tetrachloroethane	2769.99
2-methyl-cyclohexyl acetate	480.51
tetrabutyl urea	327.77
diisobutyl methanol	277.28
2-phenylethanol	703.91
styrene	637.36
dioctyl adipate	369.64
dimethyl sulfate	740.44
ethyl butyrate	501.27
methyl lactate	565.9
butyl lactate	510.71
diethyl carbonate	348.92
propanediol butyl ether	752.11
triethyl orthoformate	408.79
p-tert-butyltoluene	262.51
methyl 4-tert-butylbenzoate	595.57
morpholine	2219.87
tert-butylamine	1138.26
n-dodecanol	189.03
dimethoxymethane	1134.78
ethylene carbonate	888.16
cyrene	507.08
2-ethoxyethyl acetate	724.29
2-ethylhexyl acetate	720.42
1,2,4-trichlorobenzene	1197.32
4-methylpyridine	1741.36
dibutyl ether	489.58
2,6-dimethyl-4-heptanol	277.28
DEF	1248.26
dimethyl isosorbide	862.95
tetrachloroethylene	1807.02
eugenol	507.13
triacetin	724.8
span 80	582.68
1,4-butanediol	336.61
1,1-dichloroethane	2027.49
2-methyl-1-pentanol	711.63
methyl formate	738.93
2-methyl-1-butanol	1150.23
n-decane	55.86
butyronitrile	1045.01
3,7-dimethyl-1-octanol	504.39
1-chlorooctane	313.32
1-chlorotetradecane	100.9
n-nonane	56.25
undecane	37.15
tert-butylcyclohexane	178.35
cyclooctane	134.21
cyclopentanol	1121.39
tetrahydropyran	2194.8
tert-amyl methyl ether	1254.76
2,5,8-trioxanonane	844.72
1-hexene	842.47
2-isopropoxyethanol	638.43
2,2,2-trifluoroethanol	526.9
methyl butyrate	799.04

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